7,8-dimethoxy-2-(2-phenylethyl)-3-sulfanylidene-2,3,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-1(5H)-one
Chemical Structure Depiction of
7,8-dimethoxy-2-(2-phenylethyl)-3-sulfanylidene-2,3,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-1(5H)-one
7,8-dimethoxy-2-(2-phenylethyl)-3-sulfanylidene-2,3,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-1(5H)-one
Compound characteristics
| Compound ID: | 8249-4004 |
| Compound Name: | 7,8-dimethoxy-2-(2-phenylethyl)-3-sulfanylidene-2,3,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-1(5H)-one |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C21 H22 N2 O3 S |
| Smiles: | COc1cc2CC3C(N(CCc4ccccc4)C(N3Cc2cc1OC)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9755 |
| logD: | 2.9755 |
| logSw: | -3.3215 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 34.551 |
| InChI Key: | YMCFXHFTVLJARM-QGZVFWFLSA-N |